2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid
TL;DR: 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid (CAS 21957-56-2) is a chemical compound with molecular formula C6H8N4O4 and molecular weight 200.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanoic acid
Also Known As: BAS 00131297, 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid, 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanoic acid, (2S)-2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanoic acid, 2-[(3,5-dioxo-2H,4H-1,2,4-triazin-6-yl)amino]propanoic acid
| Molecular Formula | C6H8N4O4 |
|---|---|
| Molecular Weight | 200.05 g/mol |
| LogP | -1.6568 |
| Topological Polar Surface Area | 127.94 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.05455 |
| Heavy Atoms | 14 |
| Complexity | 447.63498 |
Chemical Identifiers
| CAS Number | 21957-56-2 |
|---|---|
| SMILES | CC(C(=O)O)NC1=NNC(=O)NC1=O |
Product Overview
2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid (CAS 21957-56-2), with molecular formula C6H8N4O4 and molecular weight 200.05 g/mol. IUPAC: 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanoic acid.
Chemical Property Profile of 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid
Property Insights of 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid
The XLogP value of -1.6568 indicates that 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 127.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid. Following Lipinski's Rule of Five, 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid?
The CAS number of 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid is 21957-56-2.
What is the molecular formula of 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid?
The molecular formula of 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid is C6H8N4O4.
What is the molecular weight of 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid?
The molecular weight of 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid is 200.05 g/mol.
Where can I buy 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid?
You can request a quote for 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((3,5-Dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.